[(2S)-3-(4-cyano-2-methoxy-phenoxy)-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: [(2S)-3-(4-cyano-2-methoxy-phenoxy)-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2S)-3-(4-cyano-2-methoxy-phenoxy)-2-hydroxy-propyl]-methyl-ammonium CAS Name: [(2S)-3-(4-cyano-2-methoxyphenoxy)-2-hydroxypropyl]-methylammonium IUPAC Name: [(2S)-3-(4-cyano-2-methoxyphenoxy)-2-hydroxypropyl]-methylazanium Traditional Name: [(2S)-3-(4-cyano-2-methoxy-phenoxy)-2-hydroxy-propyl]-methyl-ammonium Formula: C12H17N2O3+ MolecularWeight: 237.27498

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(COC1=C(C=C(C=C1)C#N)OC)O

Isomeric SMILES

C[NH2+]C[C@@H](COC1=C(C=C(C=C1)C#N)OC)O

InChI

InChI=1S/C12H16N2O3/c1-14-7-10(15)8-17-11-4-3-9(6-13)5-12(11)16-2/h3-5,10,14-15H,7-8H2,1-2H3/p+1/t10-/m0/s1